Geometry & MOs

Info

ID:

164171

PubChem CID:

74382170

Reduced:

N3O7C48H71 (1)

Stoich.:

A3B7C48D71 (1)

Weight, g/mol:

503.151492

ΔHf, kcal/mol:

-343.54

Dipole, Da:

2.26

IP(EA), eV:

 -9.66(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-3-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-phenylmethylidene]-2-oxo-1H-indole-5-sulfonamide

Drug info:

PubChemData

Smile

CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)CC(C)(C)C(=O)O)C)C(=O)NCC6=CC=CC=C6C(=O)NCCNC(=O)C

DOS

IR

Vibrations